{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.54387 0 0 ] "si-unit" "m" "si-value" [ 5.543870000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0557634 5.4256 0 ] "si-unit" "m" "si-value" [ 5.57634e-12 5.4256e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.136783 0.0146252 5.57946 ] "si-unit" "m" "si-value" [ -1.36783e-11 1.46252e-12 5.57946e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00414448 -0.00753772 -0.01957 ] [ 1.42138 1.28295 1.34172 ] [ -0.029535 2.68233 2.78427 ] [ 1.30944 3.95933 4.27313 ] [ 2.73162 -0.0222546 2.83084 ] [ 4.1911 1.38332 4.19541 ] [ 2.73336 2.72737 0.0657353 ] [ 3.99828 4.07749 1.28506 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.14448e-13 -7.537720000000001e-13 -1.957e-12 ] [ 1.42138e-10 1.28295e-10 1.34172e-10 ] [ -2.9535e-12 2.68233e-10 2.78427e-10 ] [ 1.30944e-10 3.95933e-10 4.27313e-10 ] [ 2.73162e-10 -2.22546e-12 2.83084e-10 ] [ 4.1911e-10 1.38332e-10 4.19541e-10 ] [ 2.73336e-10 2.72737e-10 6.57353e-12 ] [ 3.99828e-10 4.07749e-10 1.28506e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.31417660000000003 -1.6057491000000004 0.9656478000000002 ] [ -0.8443246000000002 0.5793805000000001 1.0807580000000003 ] [ 0.15174170000000003 0.4613042000000001 -1.3059341000000002 ] [ -0.9921785000000002 2.3257449000000006 -2.2250526000000006 ] [ -0.2835828000000001 -0.18028210000000003 0.6071156000000001 ] [ -2.5674991000000005 0.33953410000000006 -0.3843024000000001 ] [ 0.5990679000000001 -3.466058500000001 -1.2857468000000003 ] [ 3.6225989000000007 1.5461260000000003 2.5475146000000004 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.033664033224334e-10 -2.572693666890642e-09 1.547138329086954e-09 ] [ -1.352757134486312e-09 9.282698916474145e-10 1.731565200342567e-09 ] [ 2.431170041404474e-10 7.390908043168476e-10 -2.092337083325489e-09 ] [ -1.589645196360413e-09 3.726254104724835e-09 -3.564927255770255e-09 ] [ -4.543497322210024e-10 -2.888437657687277e-10 9.727064204429645e-10 ] [ -4.113587031945042e-09 5.439935969843694e-10 -6.157203205973302e-10 ] [ 9.598125836517525e-10 -5.553237895025118e-09 -2.059993463228414e-09 ] [ 5.804043264115799e-09 2.477166930011022e-09 4.081568333266664e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.845132 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.743023245988995e-18 } }